octyl 2-sulfooxyoctanoate

Systemtic Name: octyl 2-sulfooxyoctanoate Openeye Name: octyl 2-sulfooxyoctanoate CAS Name: 2-sulfooxyoctanoic acid octyl ester IUPAC Name: octyl 2-sulfooxyoctanoate Traditional Name: 2-sulfoxycaprylic acid octyl ester Formula: C16H32O6S MolecularWeight: 352.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CCCCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)C(CCCCCC)OS(=O)(=O)O

InChI

InChI=1S/C16H32O6S/c1-3-5-7-9-10-12-14-21-16(17)15(22-23(18,19)20)13-11-8-6-4-2/h15H,3-14H2,1-2H3,(H,18,19,20)